SCHEMBL2071081

SCHEMBL2071081

COC(=O)/C(=N\N)C(=O)c1c(F)cccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GAA P10253 6/20 0.43
POLB P06746 3/20 0.43
RAB9A P51151 3/20 0.41
MAPT P10636 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
PBRM1 Q86U86 1/20 0.41
JAK2 O60674 1/20 0.41
JAK1 P23458 1/20 0.41
TYK2 P29597 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MEN1 O00255 1/20 0.40
KMT2A Q03164 1/20 0.40
LMNA P02545 1/20 0.40
NPC1 O15118 1/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2071083 1.00 GAA (0.43) GAAPOLBRAB9AMAPTSMN1; SMN2
SCHEMBL25674029 0.83 POLB (0.43) GAAPOLBRAB9ASMN1; SMN2MEN1
SCHEMBL2070179 0.75 L3MBTL1 (0.45) GAAPOLBRAB9AMAPTNPSR1
SCHEMBL946028 0.74 LMNA (0.55) GAAPOLBRAB9AMAPTSMN1; SMN2
SCHEMBL4761403 0.73 GAA (0.44) GAAPOLBRAB9AMAPTNPSR1
SCHEMBL6935698 0.72 GAA (0.47) GAAPOLBRAB9AMAPTNPSR1
SCHEMBL6935703 0.72 GAA (0.47) GAAPOLBRAB9AMAPTNPSR1
SCHEMBL6935828 0.71 GAA (0.46) GAAPOLBRAB9AMAPTSMN1; SMN2
SCHEMBL6935826 0.71 GAA (0.46) GAAPOLBRAB9AMAPTSMN1; SMN2
SCHEMBL6935825 0.71 GAA (0.46) GAAPOLBRAB9AMAPTSMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2522670-A1 Heterocyclic CRF receptor antagonists Takeda Pharmaceutical Company Limited (JP) 2012-11-14 EP disclosed
US-7897607-B2 Cyclic compounds TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2011-03-01 US disclosed
EP-1732541-A4 CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL (JP) 2008-03-05 EP disclosed
US-20070179165-A1 Cyclic compounds GYORKOS ALBERT C 2007-08-02 US disclosed
EP-1732541-A2 CYCLIC COMPOUNDS Takeda Pharmaceutical Company Limited (JP) 2006-12-20 EP disclosed
WO-2005099688-A2 CYCLIC COMPOUNDS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2005-10-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070179165-A1 Cyclic compounds CRHR1, CRHR2, MC2R GAA 4637/4885POLB 4201/4885RAB9A 1804/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.